Home Carboxys 2-(tert-butoxy)pyridine-4-carboxylic acid

2-(tert-butoxy)pyridine-4-carboxylic acid

CAS No.:
1039950-66-7
Catalog Number:
AG01A3X0
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
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Product Description
Catalog Number:
AG01A3X0
Chemical Name:
2-(tert-butoxy)pyridine-4-carboxylic acid
CAS Number:
1039950-66-7
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD11196483
IUPAC Name:
2-[(2-methylpropan-2-yl)oxy]pyridine-4-carboxylic acid
InChI:
InChI=1S/C10H13NO3/c1-10(2,3)14-8-6-7(9(12)13)4-5-11-8/h4-6H,1-3H3,(H,12,13)
InChI Key:
UHYLPLBJEKZQHO-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccnc(c1)OC(C)(C)C
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties